[CPMD-list] Please help with NLCC in Dfhipp and Gianozzi's program
LAMAS, EDUARDO JORGE
LAMAS at engr.sc.edu
Thu Jul 24 21:24:13 CEST 2003
Dear All:
I was plotting the rho from the nonlinear core corrections that comes
as an output
from Gianozzi's PP generation program and comparing it with the one
generated by
Dfhipp program.
But when plotting both functions I found the same shape and the same
decay but with a factor of about 30 in the y access.
Could somebody please explain me what that factor is?
Thanks in advance,
Eduardo
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